Vitas-M small molecule compound
N-(3,4-dimethoxyphenyl)-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL340482
SMILES COc1cc(ccc1OC)NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCC3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H25N3O5S2 MW 511.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5S2/c1-31-18-10-9-15(12-19(18)32-2)26-21(29)14-34-25-27-23-22(17-7-3-4-8-20(17)35-23)24(30)28(25)13-16-6-5-11-33-16/h5-6,9-12H,3-4,7-8,13-14H2,1-2H3,(H,26,29)InChIKey
NXRQYYRNSHQGLW-UHFFFAOYSA-NSynonyms
573934-84-6573934846
COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC5=CC=CO5)OC
InChI=1SC25H25N3O5S2c1311810915(1219(18)322)2621(29)143425272322(17734820(17)3523)24(30)28(25)131665113316h56912H34781314H212H3(H2629)
MFCD04019962
N(34dimethoxyphenyl)2((3(furan2ylmethyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(34dimethoxyphenyl)2((3(furan2ylmethyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(34dimethoxyphenyl)2((3(furan2ylmethyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002195839
ZINC02195839
ZINC2195839
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